2-[5-(4-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N,N-dipropylacetamide
Chemical Structure Depiction of
2-[5-(4-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N,N-dipropylacetamide
2-[5-(4-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N,N-dipropylacetamide
Compound characteristics
| Compound ID: | P032-1170 |
| Compound Name: | 2-[5-(4-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N,N-dipropylacetamide |
| Molecular Weight: | 401.89 |
| Molecular Formula: | C20 H24 Cl N5 O2 |
| Smiles: | CCCN(CCC)C(CN1C(N2C(C=C(C)N=C2c2ccc(cc2)[Cl])=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3783 |
| logD: | 3.3604 |
| logSw: | -3.7576 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.908 |
| InChI Key: | ILCFXCWYHWZMDZ-UHFFFAOYSA-N |